(Z)-5-(2-fluoropropyl)-4,7-dimethylnon-4-ene

C14H27F — CID 89247497

IUPAC(Z)-5-(2-fluoropropyl)-4,7-dimethylnon-4-ene
SMILESCCC/C(C)=C(\CC(C)F)CC(C)CC
InChIInChI=1S/C14H27F/c1-6-8-12(4)14(10-13(5)15)9-11(3)7-2/h11,13H,6-10H2,1-5H3/b14-12-
InChIKeyCBPAWCSHQFQWSH-OWBHPGMISA-N
MW214.37 g/mol
LogP5.29
Rot. Bonds7

About (Z)-5-(2-fluoropropyl)-4,7-dimethylnon-4-ene

(Z)-5-(2-fluoropropyl)-4,7-dimethylnon-4-ene (PubChem CID 89247497) has the molecular formula C14H27F and a molecular weight of 214.37 g/mol. Its IUPAC name is (Z)-5-(2-fluoropropyl)-4,7-dimethylnon-4-ene.

Molecular Properties

Compound Name(Z)-5-(2-fluoropropyl)-4,7-dimethylnon-4-ene
PubChem CID89247497
Molecular FormulaC14H27F
Molecular Weight214.37 g/mol
Exact Mass214.21
IUPAC Name(Z)-5-(2-fluoropropyl)-4,7-dimethylnon-4-ene
SMILESCCC/C(C)=C(\CC(C)F)CC(C)CC
InChIInChI=1S/C14H27F/c1-6-8-12(4)14(10-13(5)15)9-11(3)7-2/h11,13H,6-10H2,1-5H3/b14-12-
InChIKeyCBPAWCSHQFQWSH-OWBHPGMISA-N
XLogP5.29
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500214.37
LogP ≤ 55.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (Z)-5-(2-fluoropropyl)-4,7-dimethylnon-4-ene?
The IUPAC name of (Z)-5-(2-fluoropropyl)-4,7-dimethylnon-4-ene (CID 89247497) is (Z)-5-(2-fluoropropyl)-4,7-dimethylnon-4-ene.
What is the SMILES notation for (Z)-5-(2-fluoropropyl)-4,7-dimethylnon-4-ene?
The canonical SMILES for (Z)-5-(2-fluoropropyl)-4,7-dimethylnon-4-ene is CCC/C(C)=C(\CC(C)F)CC(C)CC.
What is the InChIKey of (Z)-5-(2-fluoropropyl)-4,7-dimethylnon-4-ene?
The InChIKey is CBPAWCSHQFQWSH-OWBHPGMISA-N. The full InChI is InChI=1S/C14H27F/c1-6-8-12(4)14(10-13(5)15)9-11(3)7-2/h11,13H,6-10H2,1-5H3/b14-12-.
What are the key properties of (Z)-5-(2-fluoropropyl)-4,7-dimethylnon-4-ene?
(Z)-5-(2-fluoropropyl)-4,7-dimethylnon-4-ene has a molecular weight of 214.37 g/mol, XLogP of 5.29, 7 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-5-(2-fluoropropyl)-4,7-dimethylnon-4-ene is sourced from PubChem (CID 89247497), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).